MolMiner: Toward Controllable, Three‐Dimensional‐Aware, Fragment‐Based Molecular Design
MolMiner is a fragment‐based, geometry‐aware, and order‐agnostic generative model for molecular design with strong inductive biases. Using symmetry‐aware fragment assembly, dynamic three‐dimensional geometry, and multi‐property conditioning, MolMiner enables interpretable and controllable molecular generation.
Raul Ortega‐Ochoa +2 more
wiley +1 more source
Word Trigram Frequency Predicts Failure to Detect Word Transpositions: Implications for Rational Inference in Reading. [PDF]
Huang KJ, Staub A.
europepmc +1 more source
Artificial intelligence is redefining network pharmacology (NP). By integrating knowledge graph engineering, geometric deep learning, multiomics anchoring, and generative reasoning, AI‐driven NP (AI‐NP) transforms static target mapping into dynamic, predictive modeling.
Cong Wang +9 more
wiley +1 more source
Realist methodologies informing the development, implementation, and scale-up of complex socio-medical interventions: A scoping review protocol. [PDF]
Ahmed MK +5 more
europepmc +1 more source
Double Helix Structure for Stable Flexural Actuation in Soft Robotics
This work introduces a double‐helical architecture for soft robotic actuators that enhances twisting resistance, increases output force, and minimizes undesired deformation. Actuators driven by shape‐memory alloy wires exhibit a roughly fivefold higher torsional/flexural stiffness ratio and 50% greater force output.
Louis Plottel +4 more
wiley +1 more source
Complex transition pathways in boiling and cavitation. [PDF]
Gallo M +3 more
europepmc +1 more source
A Two‐Stage Characterization Pipeline and Open‐Source Framework for Reproducible Tactile Sensing
The same soft tactile sensor returns different numbers when embodied in different robots. This is an Embodiment Gap that no shared framework currently captures transparently. A two‐stage characterization pipeline, paired with a FAIR open‐source digital datasheet, decouples intrinsic sensor behavior from embodiment effects and condenses cross‐laboratory
Matteo Lo Preti +6 more
wiley +1 more source
The Effects of Humor in the Media: A Critical Review of Experimental Research. [PDF]
Miczo N, Zhao D.
europepmc +1 more source
Artificial Intelligence for Advanced Functional Materials: Progress and Emerging Frontiers
Artificial intelligence is transforming the discovery of functional materials by linking synthesis, characterization, simulation, and design in unified workflows. Advances in machine learning, autonomous experimentation, and foundation models are accelerating innovation across energy, electronics, and biomedicine, while revealing new frontiers for ...
Cristiano Malica +38 more
wiley +1 more source
Comparative Analysis of Model‐Agnostic Explanation Methods in Materials Science
To address the critical lack of explainable artificial intelligence (XAI) benchmarks in materials science, we present a quantitative and qualitative analysis of six XAI methods applied to molecular fingerprints. Our results reveal significant discrepancies in feature importance rankings, demonstrating that the chosen explanation approach introduces ...
Anna Przybyłowska +7 more
wiley +1 more source

